2-[4-(4-chlorobenzoyl)-1,4-diazepan-1-yl]-5-[(cyclopentanecarbonyl)amino]-N,N-diethylbenzamide
Chemical Structure Depiction of
2-[4-(4-chlorobenzoyl)-1,4-diazepan-1-yl]-5-[(cyclopentanecarbonyl)amino]-N,N-diethylbenzamide
2-[4-(4-chlorobenzoyl)-1,4-diazepan-1-yl]-5-[(cyclopentanecarbonyl)amino]-N,N-diethylbenzamide
Compound characteristics
| Compound ID: | V013-0323 |
| Compound Name: | 2-[4-(4-chlorobenzoyl)-1,4-diazepan-1-yl]-5-[(cyclopentanecarbonyl)amino]-N,N-diethylbenzamide |
| Molecular Weight: | 525.09 |
| Molecular Formula: | C29 H37 Cl N4 O3 |
| Smiles: | CCN(CC)C(c1cc(ccc1N1CCCN(CC1)C(c1ccc(cc1)[Cl])=O)NC(C1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4538 |
| logD: | 4.4537 |
| logSw: | -4.5708 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.758 |
| InChI Key: | IBYOBCUMCWEPKR-UHFFFAOYSA-N |